SCHEMBL5333207

SCHEMBL5333207

c1ccc(-c2cnc(Nc3cccc4cc[nH]c34)o2)cc1

nearest known ligand 0.54

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KDR P35968 12/20 0.54
FLT1 P17948 10/20 0.54
FLT4 P35916 10/20 0.54
VCP P55072 1/20 0.48
TRPV1 Q8NER1 4/20 0.47
IMPDH2 P12268 2/20 0.44
P2RY1 P47900 1/20 0.44

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL5349266 0.89 SIRT7 (0.51) KDRFLT1FLT4VCPTRPV1
SCHEMBL5336394 0.81 PRKCQ (0.55) KDRFLT1FLT4
SCHEMBL5343623 0.80 KDR (0.54) KDRFLT1FLT4VCPTRPV1
SCHEMBL5322052 0.74 TRPV1 (0.75) KDRFLT1FLT4VCPTRPV1
SCHEMBL5319980 0.73 IMPDH2 (0.61) KDRFLT1FLT4VCPIMPDH2
SCHEMBL5318136 0.73 IMPDH2 (0.61) KDRFLT1FLT4VCPIMPDH2
SCHEMBL5318816 0.72 SIRT7 (0.51) KDRFLT1FLT4VCPTRPV1
Gw549390X SCHEMBL3295009 0.71 KDR (1.00) KDRFLT1FLT4VCPIMPDH2
SCHEMBL5232183 0.70 KDR (0.97) KDRFLT1FLT4VCPIMPDH2
SCHEMBL31060643 0.70 KDR (0.97) KDRFLT1FLT4VCPIMPDH2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007076161-A2 COMPOUNDS WITH THERAPEUTIC ACTIVITY MYRIAD GENETICS, INC (US) 2007-07-05 WO claimed
WO-2007076161-A2 COMPOUNDS WITH THERAPEUTIC ACTIVITY MYRIAD GENETICS, INC (US) 2007-07-05 WO disclosed